SCHEMBL6993214

SCHEMBL6993214

CC1(C)OC(c2ccc(S(N)(=O)=O)cc2F)=C(c2ccccc2)C1=O

nearest known ligand 0.60

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 9/20 0.42
CA1 P00915 10/20 0.41
CA2 P00918 10/20 0.41
CA9 Q16790 7/20 0.40
CA12 O43570 6/20 0.40
CA4 P22748 2/20 0.40
CA5A P35218 2/20 0.40
CA7 P43166 2/20 0.40
CA5B Q9Y2D0 2/20 0.40
CA6 P23280 1/20 0.40
CA14 Q9ULX7 1/20 0.40
PTGS1 P23219 6/20 0.39

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL3228727 0.91 PTGS2 (0.46) PTGS2CA1CA2CA9CA12
SCHEMBL7001723 0.90 PTGS2 (0.48) PTGS2CA1CA2CA9CA12
SCHEMBL6994338 0.89 PTGS2 (0.45) PTGS2PTGS1
SCHEMBL7002057 0.88 CA1 (0.40) PTGS2CA1CA2CA9CA12
SCHEMBL3231323 0.88 PTGS2 (0.41) PTGS2CA1CA2CA9CA12
SCHEMBL6997219 0.88 CA1 (0.41) PTGS2CA1CA2CA9CA12
SCHEMBL7003323 0.87 PTGS2 (0.46) PTGS2CA1CA2CA9CA12
SCHEMBL7843236 0.86 ALDH1A1 (0.38) PTGS2PTGS1
SCHEMBL7000249 0.86 KDM4E (0.39) PTGS2CA1CA2CA9CA12
SCHEMBL7003146 0.86 PTGS2 (0.42) PTGS2CA1CA2CA9CA12

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1109799-B1 4,5-DIARYL-3(2H)-FURANONE DERIVATIVES AS CYCLOOXYGENASE-2 INHIBITORS PACIFIC CORP (KR) 2003-12-17 EP claimed
US-6492416-B1 TREATING INFLAMMATION AND ASSOCIATED DISORDERS PACIFIC CORPORATION (KR) 2002-12-10 US claimed
EP-1109799-A1 4,5-DIARYL-3(2H)-FURANONE DERIVATIVES AS CYCLOOXYGENASE-2 INHIBITORS PACIFIC CORPORATION (KR) 2001-06-27 EP claimed
WO-2000061571-A1 4,5-DIARYL-3(2H)-FURANONE DERIVATIVES AS CYCLOOXYGENASE-2 INHIBITORS PACIFIC CORPORATION (KR) 2000-10-19 WO claimed
CN-1166658-C 4,5 diaryl-3 (2H) -furanone derivatives as cyclooxygenase-2 inhibitors ��ʽ����̫ƽ�� 2004-09-15 CN disclosed
EP-1109799-B1 4,5-DIARYL-3(2H)-FURANONE DERIVATIVES AS CYCLOOXYGENASE-2 INHIBITORS PACIFIC CORP (KR) 2003-12-17 EP disclosed
US-6492416-B1 TREATING INFLAMMATION AND ASSOCIATED DISORDERS PACIFIC CORPORATION (KR) 2002-12-10 US disclosed
CN-1348447-A 4,5 diaryl-3 (2H) -furanone derivatives as cyclooxygenase-2 inhibitors PACIFIC CORP (KR) 2002-05-08 CN disclosed
EP-1109799-A1 4,5-DIARYL-3(2H)-FURANONE DERIVATIVES AS CYCLOOXYGENASE-2 INHIBITORS PACIFIC CORPORATION (KR) 2001-06-27 EP disclosed
WO-2000061571-A1 4,5-DIARYL-3(2H)-FURANONE DERIVATIVES AS CYCLOOXYGENASE-2 INHIBITORS PACIFIC CORPORATION (KR) 2000-10-19 WO disclosed